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CHEBI:28755 - 2,4,6-trichlorophenol

ChEBI IDCHEBI:28755
ChEBI Name2,4,6-trichlorophenol
Stars
DefinitionA trichlorophenol with phenolic substituents on positions 2, 4 and 6.
Secondary ChEBI IDsCHEBI:898, CHEBI:19334
Last Modified15 March 2018
DownloadsMolfile
FormulaC6H3Cl3O
Net Charge0
Average Mass197.448
Monoisotopic Mass195.92495
SMILESOc1c(Cl)cc(Cl)cc1Cl
InChIInChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
InChIKeyLINPIYWFGCPVIE-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
carcinogenic agent  A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
ChEBI Ontology
Outgoing Relation(s)
2,4,6-trichlorophenol (CHEBI:28755) has role carcinogenic agent (CHEBI:50903)
2,4,6-trichlorophenol (CHEBI:28755) is a trichlorophenol (CHEBI:27102)
2,4,6-trichlorophenol (CHEBI:28755) is conjugate acid of 2,4,6-trichlorophenolate (CHEBI:140426)
Incoming Relation(s)
2,4,6-trichlorophenolate (CHEBI:140426) is conjugate base of 2,4,6-trichlorophenol (CHEBI:28755)
IUPAC Name 
2,4,6-trichlorophenol
Synonyms  Source
1,3,5-Trichloro-2-hydroxybenzeneNIST Chemistry WebBook
2,4,6-TCPUM-BBD
2,4,6-TrichlorophenolKEGG COMPOUND
Manual XrefsDatabases
2,4,6-TrichlorophenolWikipedia
c0330UM-BBD
C07098KEGG COMPOUND
T6CPDBeChem
TRICHLOROPHENOLMetaCyc
Registry NumbersSources
Gmelin:3766Gmelin
Reaxys:776729Reaxys
CAS:88-06-2NIST Chemistry WebBook
CAS:88-06-2ChemIDplus
CAS:88-06-2KEGG COMPOUND
Citations